In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2011 | 20 | Yes |
Popular Name: 6-methyl-2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-3-carboxamide 6-methyl-2-[methyl(2-piperazin-1…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | -0.71 | 1.75 | -43.06 | 4 | 6 | 1 | 79 | 278.38 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.71 | 0.39 | -10.82 | 3 | 6 | 0 | 74 | 277.372 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.71 | 2.17 | -83.97 | 5 | 6 | 2 | 80 | 279.388 | 5 | ↓ |